CHEBI:185212 - N-[(2S,3R)-1,3-Dihydroxyoctadecan-2-yl]pentacosanimidic acid

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ChEBI Name N-[(2S,3R)-1,3-Dihydroxyoctadecan-2-yl]pentacosanimidic acid
ChEBI ID CHEBI:185212
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C43H87NO3
Net Charge 0
Average Mass 666.173
Monoisotopic Mass 665.66860
InChI InChI=1S/C43H87NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(47)44-41(40-45)42(46)38-36-34-32-30-28-26-16-14-12-10-8-6-4-2/h41-42,45-46H,3-40H2,1-2H3,(H,44,47)/t41-,42+/m0/s1
InChIKey HCDLRJUFVJOBJP-ACEXITHZSA-N
SMILES O[C@H](CCCCCCCCCCCCCCC)[C@@H](NC(=O)CCCCCCCCCCCCCCCCCCCCCCCC)CO
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
ChEBI Ontology
Outgoing N-[(2S,3R)-1,3-Dihydroxyoctadecan-2-yl]pentacosanimidic acid (CHEBI:185212) is a ceramide (CHEBI:17761)
IUPAC Name
N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]pentacosanamide
Manual Xrefs Databases
24765765 ChemSpider
HMDB0011770 HMDB
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